| CAS Number | 79987-84-1 |
| Catalog Number | AG0038F4(AGN-PC-00K5VG) |
| Chemical Name | 3-(piperidin-3-yl)phenol |
| IUPAC Name | 3-piperidin-3-ylphenol |
| InChI | InChI=1S/C11H15NO/c13-11-5-1-3-9(7-11)10-4-2-6-12-8-10/h1,3,5,7,10,12-13H,2,4,6,8H2 |
| InChI Key | HYUOAVGLJXTEGX-UHFFFAOYSA-N |
| MDL Number | MFCD17486858 |
| Molecular Formula | C11H15NO |
| Molecular Weight | 177.2429 |
| SMILES | Oc1cccc(c1)C1CCCNC1 |
| Synonyms | 3-(piperidin-3-yl)phenol,
79987-84-1,
3-(3-hydroxyphenyl)piperidine,
Phenol, 3-(3-piperidinyl)-,
ACMC-20lrhs,
ACMC-20lrht,
3-m-hydroxyphenyl-piperidine,
SCHEMBL566627,
CHEMBL305415,
CTK2G3201,
HYUOAVGLJXTEGX-UHFFFAOYSA-N,
FT-0733957,
3-(3-piperidinyl)Phenol,
Phenol, 3-(3R)-3-piperidinyl-,
Phenol, 3-(3S)-3-piperidinyl-,
89874-68-0,
89874-69-1,
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| Complexity | 160 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 177.115g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 177.247g/mol |
| Monoisotopic Mass | 177.115g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 32.3A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.7 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number